N-[(3,4-dimethoxyphenyl)methyl]-3-methylsulfonyl-N-(thiophen-2-ylmethyl)benzamide

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-3-methylsulfonyl-N-(thiophen-2-ylmethyl)benzamide Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-3-methylsulfonyl-N-(2-thienylmethyl)benzamide CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-3-methylsulfonyl-N-(thiophen-2-ylmethyl)benzamide IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-3-methylsulfonyl-N-(thiophen-2-ylmethyl)benzamide Traditional Name: 3-mesyl-N-(2-thenyl)-N-veratryl-benzamide Formula: C22H23NO5S2 MolecularWeight: 445.55172

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN(CC2=CC=CS2)C(=O)C3=CC(=CC=C3)S(=O)(=O)C)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CN(CC2=CC=CS2)C(=O)C3=CC(=CC=C3)S(=O)(=O)C)OC

InChI

InChI=1S/C22H23NO5S2/c1-27-20-10-9-16(12-21(20)28-2)14-23(15-18-7-5-11-29-18)22(24)17-6-4-8-19(13-17)30(3,25)26/h4-13H,14-15H2,1-3H3